2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine

C10H17N5 — CID 80648000

IUPAC2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine
SMILESCN1CCC(Nc2cncc(N)n2)CC1
InChIInChI=1S/C10H17N5/c1-15-4-2-8(3-5-15)13-10-7-12-6-9(11)14-10/h6-8H,2-5H2,1H3,(H3,11,13,14)
InChIKeyJBAUWWIJFSKKBZ-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.56
Rot. Bonds2

About 2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine

2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine (PubChem CID 80648000) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine
PubChem CID80648000
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC Name2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine
SMILESCN1CCC(Nc2cncc(N)n2)CC1
InChIInChI=1S/C10H17N5/c1-15-4-2-8(3-5-15)13-10-7-12-6-9(11)14-10/h6-8H,2-5H2,1H3,(H3,11,13,14)
InChIKeyJBAUWWIJFSKKBZ-UHFFFAOYSA-N
XLogP0.56
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine?
The IUPAC name of 2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine (CID 80648000) is 2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine.
What is the SMILES notation for 2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine?
The canonical SMILES for 2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine is CN1CCC(Nc2cncc(N)n2)CC1.
What is the InChIKey of 2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine?
The InChIKey is JBAUWWIJFSKKBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c1-15-4-2-8(3-5-15)13-10-7-12-6-9(11)14-10/h6-8H,2-5H2,1H3,(H3,11,13,14).
What are the key properties of 2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine?
2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine has a molecular weight of 207.28 g/mol, XLogP of 0.56, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine is sourced from PubChem (CID 80648000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).